6-bromanyl-2-(4-tert-butylphenyl)-4-(3,4-dimethoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-8-carboxylic acid

Systemtic Name: 6-bromanyl-2-(4-tert-butylphenyl)-4-(3,4-dimethoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-8-carboxylic acid Openeye Name: 6-bromo-2-(4-tert-butylphenyl)-4-(3,4-dimethoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-8-carboxylic acid CAS Name: 6-bromo-2-(4-tert-butylphenyl)-4-(3,4-dimethoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-8-carboxylic acid IUPAC Name: 6-bromo-2-(4-tert-butylphenyl)-4-(3,4-dimethoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-8-carboxylic acid Traditional Name: 6-bromo-2-(4-tert-butylphenyl)-4-(3,4-dimethoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-8-carboxylic acid Formula: C29H32BrNO4 MolecularWeight: 538.47268

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2=C(C(=CC(=C2)Br)C(=O)O)NC1C3=CC=C(C=C3)C(C)(C)C)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1C(C2=C(C(=CC(=C2)Br)C(=O)O)NC1C3=CC=C(C=C3)C(C)(C)C)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C29H32BrNO4/c1-16-25(18-9-12-23(34-5)24(13-18)35-6)21-14-20(30)15-22(28(32)33)27(21)31-26(16)17-7-10-19(11-8-17)29(2,3)4/h7-16,25-26,31H,1-6H3,(H,32,33)